5-N-(cyclohexylmethyl)-4-N-cyclopropyl-1H-imidazole-4,5-dicarboxamide

C15H22N4O2 — CID 46264337

IUPAC5-N-(cyclohexylmethyl)-4-N-cyclopropyl-1H-imidazole-4,5-dicarboxamide
SMILESO=C(NC1CC1)c1nc[nH]c1C(=O)NCC1CCCCC1
InChIInChI=1S/C15H22N4O2/c20-14(16-8-10-4-2-1-3-5-10)12-13(18-9-17-12)15(21)19-11-6-7-11/h9-11H,1-8H2,(H,16,20)(H,17,18)(H,19,21)
InChIKeyJEAZQDKNEYGADG-UHFFFAOYSA-N
MW290.37 g/mol
LogP1.61
Rot. Bonds5

About 5-N-(cyclohexylmethyl)-4-N-cyclopropyl-1H-imidazole-4,5-dicarboxamide

5-N-(cyclohexylmethyl)-4-N-cyclopropyl-1H-imidazole-4,5-dicarboxamide (PubChem CID 46264337) has the molecular formula C15H22N4O2 and a molecular weight of 290.37 g/mol. Its IUPAC name is 5-N-(cyclohexylmethyl)-4-N-cyclopropyl-1H-imidazole-4,5-dicarboxamide.

Molecular Properties

Compound Name5-N-(cyclohexylmethyl)-4-N-cyclopropyl-1H-imidazole-4,5-dicarboxamide
PubChem CID46264337
Molecular FormulaC15H22N4O2
Molecular Weight290.37 g/mol
Exact Mass290.17
IUPAC Name5-N-(cyclohexylmethyl)-4-N-cyclopropyl-1H-imidazole-4,5-dicarboxamide
SMILESO=C(NC1CC1)c1nc[nH]c1C(=O)NCC1CCCCC1
InChIInChI=1S/C15H22N4O2/c20-14(16-8-10-4-2-1-3-5-10)12-13(18-9-17-12)15(21)19-11-6-7-11/h9-11H,1-8H2,(H,16,20)(H,17,18)(H,19,21)
InChIKeyJEAZQDKNEYGADG-UHFFFAOYSA-N
XLogP1.61
TPSA86.88 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.37
LogP ≤ 51.61
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclohexyl-5-hydroxy-6-oxo-1H-pyrimidine-4-carboxamide
CID 136599328
4-(thiolan-3-ylmethylcarbamoyl)-1H-imidazole-5-carboxylic acid
CID 107295054
5-(4-benzylpiperazine-1-carbonyl)-N-cyclohexyl-1H-imidazole-4-carboxamide
CID 46264397
4-[(1-methylsulfonylpiperidin-3-yl)methylcarbamoyl]-1H-imidazole-5-carboxylic acid
CID 77078744
1-(cyclooctylmethyl)-3-cyclopropylurea
CID 87025156
1-cyclododecyl-3-(cyclohexylmethyl)urea
CID 108902864
4-[[(1R,2R)-2-hydroxycyclohexyl]carbamoyl]-1H-imidazole-5-carboxylic acid
CID 107214863
4-(3-cyclohexylsulfanylpropylcarbamoyl)-1H-imidazole-5-carboxylic acid
CID 74232219
4-N-[4-[(2-chloro-4-fluorophenyl)carbamoyl]cyclohexyl]-5-N-ethyl-1H-imidazole-4,5-dicarboxamide
CID 122679352
N-(cyclohexylmethyl)-1H-pyrazole-4-carboxamide
CID 6734414
N-[1-(cyclohexylmethyl)-5-oxopyrrolidin-3-yl]-5-methyl-1H-imidazole-4-carboxamide
CID 56885981
5-N-methyl-4-N-[4-[methyl-(2-methylphenyl)carbamoyl]cyclohexyl]-1H-imidazole-4,5-dicarboxamide
CID 122679392

Frequently Asked Questions

What is the IUPAC name of 5-N-(cyclohexylmethyl)-4-N-cyclopropyl-1H-imidazole-4,5-dicarboxamide?
The IUPAC name of 5-N-(cyclohexylmethyl)-4-N-cyclopropyl-1H-imidazole-4,5-dicarboxamide (CID 46264337) is 5-N-(cyclohexylmethyl)-4-N-cyclopropyl-1H-imidazole-4,5-dicarboxamide.
What is the SMILES notation for 5-N-(cyclohexylmethyl)-4-N-cyclopropyl-1H-imidazole-4,5-dicarboxamide?
The canonical SMILES for 5-N-(cyclohexylmethyl)-4-N-cyclopropyl-1H-imidazole-4,5-dicarboxamide is O=C(NC1CC1)c1nc[nH]c1C(=O)NCC1CCCCC1.
What is the InChIKey of 5-N-(cyclohexylmethyl)-4-N-cyclopropyl-1H-imidazole-4,5-dicarboxamide?
The InChIKey is JEAZQDKNEYGADG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4O2/c20-14(16-8-10-4-2-1-3-5-10)12-13(18-9-17-12)15(21)19-11-6-7-11/h9-11H,1-8H2,(H,16,20)(H,17,18)(H,19,21).
What are the key properties of 5-N-(cyclohexylmethyl)-4-N-cyclopropyl-1H-imidazole-4,5-dicarboxamide?
5-N-(cyclohexylmethyl)-4-N-cyclopropyl-1H-imidazole-4,5-dicarboxamide has a molecular weight of 290.37 g/mol, XLogP of 1.61, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-N-(cyclohexylmethyl)-4-N-cyclopropyl-1H-imidazole-4,5-dicarboxamide is sourced from PubChem (CID 46264337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).